2-azanyl-4-[2,6-bis(chloranyl)phenyl]-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-[2,6-bis(chloranyl)phenyl]-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-4-(2,6-dichlorophenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-4-(2,6-dichlorophenyl)-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(2,6-dichlorophenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-4-(2,6-dichlorophenyl)-5-keto-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C16H12Cl2N2O2 MolecularWeight: 335.18468

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=C(O2)N)C#N)C3=C(C=CC=C3Cl)Cl)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C(=C(O2)N)C#N)C3=C(C=CC=C3Cl)Cl)C(=O)C1

InChI

InChI=1S/C16H12Cl2N2O2/c17-9-3-1-4-10(18)14(9)13-8(7-19)16(20)22-12-6-2-5-11(21)15(12)13/h1,3-4,13H,2,5-6,20H2